4-(6-oxo-3-phenylpyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-7(6H)-yl)butanoic acid
Chemical Structure Depiction of
4-(6-oxo-3-phenylpyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-7(6H)-yl)butanoic acid
4-(6-oxo-3-phenylpyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-7(6H)-yl)butanoic acid
Compound characteristics
| Compound ID: | Y020-3335 |
| Compound Name: | 4-(6-oxo-3-phenylpyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-7(6H)-yl)butanoic acid |
| Molecular Weight: | 349.35 |
| Molecular Formula: | C18 H15 N5 O3 |
| Smiles: | C(CC(O)=O)CN1C=CC2=C(C1=O)N=Nc1c(cnn12)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9521 |
| logD: | -0.8614 |
| logSw: | -2.4573 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.031 |
| InChI Key: | SSMOBVBGTIIFCO-UHFFFAOYSA-N |